Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.55 |
| ▸ | CDK1 | P06493 | 4/20 | 0.55 |
| ▸ | ABL1 | P00519 | 1/20 | 0.55 |
| ▸ | PRKCA | P17252 | 1/20 | 0.55 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.50 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.50 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | GALR3 | O60755 | 1/20 | 0.47 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CSF1R | P07333 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8580393 | 1.00 | EGFR (0.55) | EGFRCDK1ABL1PRKCACCNB2 | |
| SCHEMBL8578059 | 0.93 | EGFR (0.51) | EGFRCDK1ABL1PRKCACCNB2 | |
| SCHEMBL8581912 | 0.93 | EGFR (0.51) | EGFRCDK1ABL1PRKCACCNB2 | |
| SCHEMBL8578063 | 0.93 | EGFR (0.51) | EGFRCDK1ABL1PRKCACCNB2 | |
| SCHEMBL8581825 | 0.88 | EGFR (0.49) | EGFRCDK1ABL1PRKCASRC | |
| SCHEMBL8579768 | 0.88 | EGFR (0.49) | EGFRCDK1ABL1PRKCASRC | |
| SCHEMBL8579766 | 0.88 | EGFR (0.47) | EGFRCDK1ABL1PRKCASMN1; SMN2 | |
| SCHEMBL8651281 | 0.88 | EGFR (0.47) | EGFRCDK1ABL1PRKCASMN1; SMN2 | |
| SCHEMBL8579778 | 0.88 | EGFR (0.47) | EGFRCDK1ABL1PRKCASMN1; SMN2 | |
| SCHEMBL8577216 | 0.86 | EGFR (0.52) | EGFRCDK1ABL1PRKCACCNB2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998014449-A1 | FUSED PYRAZOLE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION | NOVARTIS AG (CH) | 1998-04-09 | — | — | WO | claimed |